Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.51 |
| ▸ | CA12 | O43570 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA9 | Q16790 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
| ▸ | MMP8 | P22894 | 1/20 | 0.40 |
| ▸ | ZDHHC20 | Q5W0Z9 | 2/20 | 0.38 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.34 |
| ▸ | TUBB | P07437 | 1/20 | 0.34 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.34 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3263945 | 0.86 | TSHR (0.50) | TSHRCA12CA1CA9HPGD | |
| SCHEMBL28273368 | 0.82 | TSHR (0.49) | TSHRCA12CA1CA9HPGD | |
| SCHEMBL9486295 | 0.80 | TSHR (0.44) | TSHRHPGDMMP1MMP2MMP3 | |
| SCHEMBL14313840 | 0.79 | TSHR (0.53) | TSHRHPGDZDHHC20ZDHHC2FAAH | |
| SCHEMBL14313839 | 0.79 | TSHR (0.53) | TSHRHPGDZDHHC20ZDHHC2FAAH | |
| SCHEMBL10893713 | 0.79 | CYP3A4 (0.37) | TSHRALDH1A1CYP3A4TDP1MAPT | |
| SCHEMBL9512523 | 0.79 | CA12 (0.47) | TSHRCA12CA1CA9HPGD | |
| SCHEMBL4346470 | 0.78 | CA12 (0.50) | CA12CA1CA9MMP1MMP2 | |
| SCHEMBL6332036 | 0.77 | TSHR (0.56) | TSHRHPGDZDHHC20ZDHHC2FAAH | |
| SCHEMBL14229115 | 0.77 | CA12 (0.39) | TSHRCA12CA1CA9MMP1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0579102-B1 | Liquid chromatography stationary phases with reduced silanol interactions | WATERS INVESTMENTS LTD (US) | 1997-09-17 | — | — | EP | disclosed |
| US-5374755-A | Silica substrate with silanol surface groups blocked by (substituted)dialkylcarbamates | MILLIPORE CORPORATION (US) | 1994-12-20 | — | — | US | disclosed |
| EP-0579102-A1 | Liquid chromatography stationary phases with reduced silanol interactions | WATERS INVESTMENTS LIMITED (US) | 1994-01-19 | — | — | EP | disclosed |